(E)-3-[4-[1-azanyl-1-oxidanylidene-3-phenyl-3-(2-piperidin-1-ylphenyl)propan-2-yl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[1-azanyl-1-oxidanylidene-3-phenyl-3-(2-piperidin-1-ylphenyl)propan-2-yl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[1-carbamoyl-2-phenyl-2-[2-(1-piperidyl)phenyl]ethyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[1-amino-1-oxo-3-phenyl-3-[2-(1-piperidinyl)phenyl]propan-2-yl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[1-amino-1-oxo-3-phenyl-3-(2-piperidin-1-ylphenyl)propan-2-yl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[1-carbamoyl-2-phenyl-2-(2-piperidinophenyl)ethyl]phenyl]acrylic acid Formula: C29H30N2O3 MolecularWeight: 454.5601

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=CC=C2C(C3=CC=CC=C3)C(C4=CC=C(C=C4)C=CC(=O)O)C(=O)N

Isomeric SMILES

C1CCN(CC1)C2=CC=CC=C2C(C3=CC=CC=C3)C(C4=CC=C(C=C4)/C=C/C(=O)O)C(=O)N

InChI

InChI=1S/C29H30N2O3/c30-29(34)28(23-16-13-21(14-17-23)15-18-26(32)33)27(22-9-3-1-4-10-22)24-11-5-6-12-25(24)31-19-7-2-8-20-31/h1,3-6,9-18,27-28H,2,7-8,19-20H2,(H2,30,34)(H,32,33)/b18-15+